Vitas-M small molecule compound

methyl 3-[({[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetyl)amino]benzoate

Catalog ID
STK239242
SMILES COC(=O)c1cccc(c1)NC(=O)CSc1snc(n1)SC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H13N3O3S3 MW 355.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S3/c1-19-11(18)8-4-3-5-9(6-8)14-10(17)7-21-13-15-12(20-2)16-22-13/h3-6H,7H2,1-2H3,(H,14,17)
InChIKey
BGEJGGXNLMIRSZ-UHFFFAOYSA-N
Synonyms
879051-30-6
879051306
COC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=NS2)SC
InChI=1SC13H13N3O3S3c11911(18)84359(68)1410(17)721131512(202)162213h36H7H212H3(H1417)
METHYL3((((3(METHYLSULFANYL)124THIADIAZOL5YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((2((3METHYLSULFANYL124THIADIAZOL5YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD07403437
ZINC000004993016
ZINC04993016
ZINC4993016

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.